#------------------------------------------------------------------------------
#$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9000602.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_9000602
_chemical_name 'Cu(IO3)2*2H2O'
loop_
_publ_author_name
'Ghose S'
'Wan C'
_journal_name_full "American Mineralogist"
_journal_volume 63
_journal_year 1978
_journal_page_first 172
_journal_page_last 179
_publ_section_title
;
 Salesite, CuIO3(OH), and Cu(IO3)2*2H2O: A comparison of the crystal
 structures and their magnetic behavior
 Locality: synthetic
;
_chemical_formula_sum 'Cu I2 O8 H4'
_cell_length_a 6.728
_cell_length_b 4.813
_cell_length_c 11.165
_cell_angle_alpha 90
_cell_angle_beta 103.34
_cell_angle_gamma 90
_cell_volume 351.788
_symmetry_space_group_name_H-M 'P 1 21/c 1'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  'x,1/2-y,1/2+z'
  '-x,1/2+y,1/2-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_Uiso_or_equiv
Cu   0.00000   0.00000   0.00000 ?
I   0.26058   0.36380   0.26659 ?
O1   0.47650   0.15520   0.34070 ?
O2   0.07050   0.19950   0.33640 ?
O3   0.21010   0.20780   0.11510 ?
O4   0.77910   0.23290   0.03110 ?
H1   0.82100   0.38300   0.07300   0.01013
H2   0.65500   0.27900  -0.04100   0.02533